4,5,6-tris(prop-1-enyl)triazine

C12H15N3 — CID 141153727

IUPAC4,5,6-tris(prop-1-enyl)triazine
SMILESCC=Cc1nnnc(C=CC)c1C=CC
InChIInChI=1S/C12H15N3/c1-4-7-10-11(8-5-2)13-15-14-12(10)9-6-3/h4-9H,1-3H3
InChIKeyCOEAPMOLVWSURS-UHFFFAOYSA-N
MW201.27 g/mol
LogP2.97
Rot. Bonds3

About 4,5,6-tris(prop-1-enyl)triazine

4,5,6-tris(prop-1-enyl)triazine (PubChem CID 141153727) has the molecular formula C12H15N3 and a molecular weight of 201.27 g/mol. Its IUPAC name is 4,5,6-tris(prop-1-enyl)triazine.

Molecular Properties

Compound Name4,5,6-tris(prop-1-enyl)triazine
PubChem CID141153727
Molecular FormulaC12H15N3
Molecular Weight201.27 g/mol
Exact Mass201.13
IUPAC Name4,5,6-tris(prop-1-enyl)triazine
SMILESCC=Cc1nnnc(C=CC)c1C=CC
InChIInChI=1S/C12H15N3/c1-4-7-10-11(8-5-2)13-15-14-12(10)9-6-3/h4-9H,1-3H3
InChIKeyCOEAPMOLVWSURS-UHFFFAOYSA-N
XLogP2.97
TPSA38.67 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.27
LogP ≤ 52.97
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4,5,6-tris(prop-1-enyl)triazine?
The IUPAC name of 4,5,6-tris(prop-1-enyl)triazine (CID 141153727) is 4,5,6-tris(prop-1-enyl)triazine.
What is the SMILES notation for 4,5,6-tris(prop-1-enyl)triazine?
The canonical SMILES for 4,5,6-tris(prop-1-enyl)triazine is CC=Cc1nnnc(C=CC)c1C=CC.
What is the InChIKey of 4,5,6-tris(prop-1-enyl)triazine?
The InChIKey is COEAPMOLVWSURS-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15N3/c1-4-7-10-11(8-5-2)13-15-14-12(10)9-6-3/h4-9H,1-3H3.
What are the key properties of 4,5,6-tris(prop-1-enyl)triazine?
4,5,6-tris(prop-1-enyl)triazine has a molecular weight of 201.27 g/mol, XLogP of 2.97, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4,5,6-tris(prop-1-enyl)triazine is sourced from PubChem (CID 141153727), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).